2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylethanenitrile

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylethanenitrile Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylacetonitrile CAS Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]acetonitrile IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylacetonitrile Traditional Name: 2-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]acetonitrile Formula: C16H23NOS MolecularWeight: 277.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCC#N

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SCC#N

InChI

InChI=1S/C16H23NOS/c1-15(2,3)12-9-11(19-8-7-17)10-13(14(12)18)16(4,5)6/h9-10,18H,8H2,1-6H3